vasp 
  6.2.1  
  16May21 (build Apr 11 2022 11:03:26) complex                          parallel 
  Lin64 
  2025 05 17 
  22:59:08 
 
 
  No title
       0
  Normal
  Normal (blocked Davidson)
   F  
       1
       2
       1
     200
       2
      -1
        0.00001000
       -0.02000000
       0
       2
       1
      400.00000000
        1.11000000      0.73000000      0.77000000      0.32000000
  Auto
       1
        0.20000000
       1
   F  
   F  
       1
 
 
  
   
    
           15.00000000       0.00000000       0.00000000 
            0.00000000      10.00000000       0.00000000 
            0.00000000       0.00000000      10.00000000 
    
       1500.00000000 
    
            0.06666667       0.00000000       0.00000000 
            0.00000000       0.10000000       0.00000000 
            0.00000000       0.00000000       0.10000000 
    
   
   
           0.16709698       0.56912279       0.72886133 
           0.37628781       0.62446309       0.69341144 
           0.27054154       0.62145961       0.73167933 
           0.39131506       0.66416185       0.50704825 
           0.42889686       0.73750946       0.81842198 
           0.16229857       0.38255187       0.74348003 
           0.11265037       0.62960815       0.57178436 
           0.12443938       0.63264602       0.84834525 
           0.46026791       0.65013039       0.47030978 
           0.37486374       0.77162052       0.49991910 
           0.34730652       0.60979365       0.43656768 
           0.49702530       0.75634968       0.78278658 
           0.43982167       0.66769891       0.90259660 
           0.09236158       0.34919855       0.74694854 
           0.19551431       0.34770923       0.83520610 
           0.19462269       0.33333452       0.65769335 
           0.14383865       0.58527538       0.48246444 
           0.11792340       0.73908713       0.56361395 
           0.04149137       0.60268720       0.57171650 
           0.39587855       0.83446387       0.84815896 
           0.53762103       0.44803004       0.68920101 
           0.49399002       0.41667406       0.67636595 
   
  
  
           1 
           2 
           3 
           4 
           5 
           6 
           7 
           8 
           9 
          10 
          11 
          12 
          13 
          14 
          15 
          16 
          17 
          18 
          19 
          20 
          21 
          22 
  
 
 
  
          1        2        2 
         0.00000000       0.00000000       0.00000000 
         1.00000000       0.00000000       0.00000000 
         0.00000000       0.50000000       0.00000000 
         0.00000000       0.00000000       0.50000000 
         0.00000000       0.00000000       0.00000000 
  
  
          0.00000000       0.00000000       0.00000000 
          0.00000000       0.50000000       0.00000000 
          0.00000000       0.00000000       0.50000000 
          0.00000000       0.50000000       0.50000000 
  
  
          0.25000000 
          0.25000000 
          0.25000000 
          0.25000000 
  
 
 
  
   No title
    F  
  
  
   normal
       400.00000000
       644.87300000
         0.00001000
       38
       10
       36
       -1
       -1
        45.00000000
        0
        0
        0
        0
         0.00000000
   
         1
          0.20000000
          0.50000000
     T  
     T  
   
   
     T  
         -0.00050000     -0.00050000     -0.00050000     -0.00050000
      -100
         2
     F  
   
   
         0
         2
         1
   
   
         1
     F  
          1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000      1.00000000
      1.00000000      1.00000000
         -1.00000000
     F  
          0.00000000      0.00000000      1.00000000
     F  
          0.00000000      0.00000000      0.00000000
     F  
   
   
     F  
     F  
   
   
       200
        -5
         2
        400.00000000
    
      T  
      F  
           0.00000000
           0.00000007
           0.30000000
          4
           0.40000000
    
   
   
          0.40000000
          1.00000000
          0.10000000
          1.60000000
          1.00000000
    
          4
      F  
        -45
         100.00000000
          1
          1
          5
    
   
   
     F  
     F  
         0
          1.00000000
       -100.00000000   -100.00000000   -100.00000000
          0.00000000
   
  
  
       80
       50
       50
      160
      100
      100
    F  
  
  
        0
       -1
        0
        2
         0.00000000
        -0.02000000
        0
         0.50000000
        -3.00000000
         1.00000000
  
  
         0.00010000
         0.00010000
        1
        1
      256
        16.00000000
  
  
        2
         0.00001000
  
  
        0
         1.11000000      0.73000000      0.77000000      0.32000000
      301
        10.00000000
       -10.00000000
         0.00000000
  
  
        1
    F  
    F  
    F  
    F  
    F  
    F  
    F  
    F  
         0.00000000      0.00000000      0.00000000      0.00000000      0.00000000      0.00000000      0.00000000
  
  
        3
        4
       -1
    T  
    F  
    F  
    F  
    F  
    F  
  
  
        3
       -1
    F  
        28.08500000     16.00000000     12.01100000      1.00000000
         0.00000000      0.00000000      0.00000000      0.00000000
         1.00000000      1.00000000      1.00000000      1.00000000
    T  
  
   T  
   F  
       0
   F  
       0
  
   --
        1
    F  
   
    F  
    F  
    F  
    F  
    F  
        -1.00000000
        0
        0
         0.00000000
         0.00000000
         0.00000000
         1.00000000
         1.00000000
         1.00000000
         1.00000000
        1
        1
        1
    F  
    F  
    F  
        0
        0
    F  
         0.00000000
         0.00000000
        0
  
  
    F  
        -0.84910000
         0.12340000
         1.00000000
         0.00000000
  
  
        0
        40.90909091
         1.00000000
  
  
    F  
    F  
    F  
    F  
        0
         0.10000000
        -1.00000000
         0.00200000
        -0.10000000
         0.00000000
         0.00000000      0.00000000      0.00000000
         0.00000000      0.00000000      0.00000000      0.00000000      0.00000000      0.00000000      0.00000000      0.00000000      0.00000000
  
  
    F  
         0.00000000      0.00000000      0.00000000
    T  
    F  
    F  
    F  
    T  
        0
         0.00000000      0.00000000      0.00000000
         0.00000000      0.00000000      0.00000000
  
  
    F  
    F  
    F  
    F  
    T  
        0
       -1     0     0     0
    F  
    F  
    F  
    F  
    F  
    F  
        2
    F  
    F  
    F  
    F  
    F  
    F  
        -2.00000000
        -2.00000000
        -1.00000000
    F  
       -1
         0.00000000
        0
        0
       -1
       -1
       -1
      200
        1
        3
        4
        0
       -30.00000000
       -30.00000000
      -200.00000000
        0
        -0.10000000
    F  
    F  
    F  
    F  
    F  
    F  
    F  
        1
        1
        1
     2800
        0
       -1
       -1
         0.80000001
         1.00000000
  
  
         0.00000000
         0.00000000      0.00000000      0.00000000
         0.00000000
         0.00000000
         0.00000000
  
  
    F  
  
 
 
        22 
         4 
  
   ion
   element
   atomtype
   
    Si   1
    Si   1
    O    2
    C    3
    C    3
    C    3
    C    3
    H    4
    H    4
    H    4
    H    4
    H    4
    H    4
    H    4
    H    4
    H    4
    H    4
    H    4
    H    4
    H    4
    H    4
    H    4
   
  
  
   type
   atomspertype
   element
   mass
   valence
   pseudopotential
   
       2Si     28.08500000      4.00000000  PAW_PBE Si 05Jan2001                  
       1O      16.00000000      6.00000000  PAW_PBE O 08Apr2002                   
       4C      12.01100000      4.00000000  PAW_PBE C 08Apr2002                   
      15H       1.00000000      1.00000000  PAW_PBE H 15Jun2001                   
   
  
 
 
  
   
          15.00000000       0.00000000       0.00000000 
           0.00000000      10.00000000       0.00000000 
           0.00000000       0.00000000      10.00000000 
   
      1500.00000000 
   
           0.06666667       0.00000000       0.00000000 
           0.00000000       0.10000000       0.00000000 
           0.00000000       0.00000000       0.10000000 
   
  
  
          0.16709698       0.56912279       0.72886133 
          0.37628781       0.62446309       0.69341144 
          0.27054154       0.62145961       0.73167933 
          0.39131506       0.66416185       0.50704825 
          0.42889686       0.73750946       0.81842198 
          0.16229857       0.38255187       0.74348003 
          0.11265037       0.62960815       0.57178436 
          0.12443938       0.63264602       0.84834525 
          0.46026791       0.65013039       0.47030978 
          0.37486374       0.77162052       0.49991910 
          0.34730652       0.60979365       0.43656768 
          0.49702530       0.75634968       0.78278658 
          0.43982167       0.66769891       0.90259660 
          0.09236158       0.34919855       0.74694854 
          0.19551431       0.34770923       0.83520610 
          0.19462269       0.33333452       0.65769335 
          0.14383865       0.58527538       0.48246444 
          0.11792340       0.73908713       0.56361395 
          0.04149137       0.60268720       0.57171650 
          0.39587855       0.83446387       0.84815896 
          0.53762103       0.44803004       0.68920101 
          0.49399002       0.41667406       0.67636595 
  
  
     T  T  T 
     T  T  T 
     F  F  F 
     T  T  T 
     T  T  T 
     T  T  T 
     T  T  T 
     T  T  T 
     T  T  T 
     T  T  T 
     T  T  T 
     T  T  T 
     T  T  T 
     T  T  T 
     T  T  T 
     T  T  T 
     T  T  T 
     T  T  T 
     T  T  T 
     F  F  F 
     T  T  T 
     T  T  T 
  
  
         -3.00000000       0.00000000       0.00010000       0.00010000 
  
 
 
  
       1.99    2.04
       2.33    2.38
   
          4.76039610 
       1366.07579710 
      -2348.30986374 
         95.10271240 
        988.89567318 
       -957.91857019 
         -0.00458313 
       -288.06340919 
       1414.08307395 
        274.62122648 
        274.62580961 
        274.62275419 
   
  
  
       3.17    3.18
       3.17    3.18
   
        -40.23220458 
        -40.21046086 
        -40.22495667 
   
  
  
       2.62    2.63
       2.62    2.63
   
       -119.05470906 
       -119.00311055 
       -119.03750955 
   
  
  
       2.60    2.61
       2.61    2.61
   
       -123.98729811 
       -123.93091996 
       -123.96850540 
   
  
  
       2.12    2.14
       2.17    2.19
   
       -124.14085710 
       -124.08443936 
       -124.12205119 
   
  
  
       2.00    2.02
       2.41    2.43
   
       -111.08717117 
       -111.03075539 
       -111.06836591 
   
  
  
       2.53    2.54
       3.57    3.58
   
       -109.56439724 
       -109.50798786 
       -109.54559411 
   
  
  
       2.58    2.59
       3.82    3.83
   
       -109.04719445 
       -108.99078788 
       -109.02839226 
   
  
  
       2.35    2.37
       2.89    2.91
   
       -108.88909752 
       -108.83269922 
       -108.87029809 
   
  
  
       2.21    2.24
       2.54    2.57
   
       -108.88010666 
       -108.82371040 
       -108.86130791 
   
  
  
       2.14    2.15
       2.50    2.52
   
       -108.87296768 
       -108.81657585 
       -108.85417040 
   
  
  
       2.51    2.53
       2.91    2.94
   
       -108.87413426 
       -108.81774187 
       -108.85533679 
   
  
  
       2.14    2.16
       2.49    2.52
   
       -108.88078058 
       -108.82438655 
       -108.86198257 
   
  
  
       2.12    2.16
       2.55    2.60
   
       -108.88392368 
       -108.82752717 
       -108.86512484 
   
  
  
       2.13    2.17
       2.53    2.57
   
       -108.88730098 
       -108.83090289 
       -108.86850162 
   
  
  
       2.03    2.21
       2.43    2.62
   
       -108.89197127 
       -108.83557434 
       -108.87317229 
   
  
  
       1.33    1.37
       1.65    1.71
   
       -108.89365134 
       -108.83725505 
       -108.87485257 
   
  
  
       0.97    1.02
       1.34    1.39
   
       -108.89448554 
       -108.83808996 
       -108.87568701